Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dqn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N ASP 1.A OD1 no hydrogen 2.823 N/A SER 5.A N ASP 1.A O no hydrogen 2.933 N/A LYS 6.A N PRO 2.A O no hydrogen 3.158 N/A LYS 6.A N MET 3.A O no hydrogen 3.219 N/A GLU 8.A N VAL 4.A O no hydrogen 3.032 N/A GLU 9.A N SER 5.A O no hydrogen 2.728 N/A LEU 10.A N LYS 6.A O no hydrogen 3.304 N/A LEU 10.A N GLY 7.A O no hydrogen 3.037 N/A PHE 11.A N GLY 7.A O no hydrogen 2.998 N/A VAL 15.A N GLY 38.A O no hydrogen 2.829 N/A ILE 17.A N GLY 36.A O no hydrogen 2.837 N/A LEU 18.A N LEU 119.A O no hydrogen 2.956 N/A VAL 19.A N GLY 34.A O no hydrogen 2.858 N/A GLU 20.A N ASN 121.A O no hydrogen 2.927 N/A LEU 21.A N VAL 32.A O no hydrogen 2.731 N/A ASP 22.A N ILE 123.A O no hydrogen 2.978 N/A GLY 23.A N PHE 30.A O no hydrogen 2.715 N/A ASP 24.A N LEU 125.A O no hydrogen 3.050 N/A VAL 25.A N HIS 28.A O no hydrogen 2.887 N/A ASN 26.A N GLY 127.A O no hydrogen 2.822 N/A ASN 26.A ND2 PHE 130.A O no hydrogen 2.976 N/A GLY 27.A N ASP 24.A OD1 no hydrogen 2.842 N/A HIS 28.A N VAL 25.A O no hydrogen 2.958 N/A PHE 30.A N GLY 23.A O no hydrogen 2.901 N/A SER 31.A N THR 53.A OG1 no hydrogen 3.087 N/A SER 31.A OG ASP 22.A OD1 no hydrogen 2.838 N/A VAL 32.A N LEU 21.A O no hydrogen 2.966 N/A SER 33.A N ILE 50.A O no hydrogen 2.970 N/A SER 33.A OG GLU 20.A OE1 no hydrogen 2.695 N/A GLY 34.A N VAL 19.A O no hydrogen 2.814 N/A GLU 35.A N LYS 48.A O no hydrogen 3.007 N/A GLY 36.A N ILE 17.A O no hydrogen 3.126 N/A GLU 37.A N THR 46.A O no hydrogen 2.861 N/A GLY 38.A N VAL 15.A O no hydrogen 2.827 N/A ASP 39.A N LYS 44.A O no hydrogen 2.769 N/A THR 41.A OG1 THR 12.A O no hydrogen 3.293 N/A TYR 42.A N ASP 39.A O no hydrogen 2.992 N/A GLY 43.A N ALA 40.A O no hydrogen 3.005 N/A LYS 44.A N ASP 39.A O no hydrogen 3.047 N/A LEU 45.A N GLU 222.A O no hydrogen 2.900 N/A THR 46.A N GLU 37.A O no hydrogen 3.019 N/A LEU 47.A N LEU 220.A O no hydrogen 2.864 N/A LYS 48.A N GLU 35.A O no hydrogen 2.893 N/A LYS 48.A NZ ASP 210.A OD2 no hydrogen 2.772 N/A LYS 48.A NZ GLU 213.A OE1 no hydrogen 2.777 N/A PHE 49.A N MET 218.A O no hydrogen 2.748 N/A ILE 50.A N SER 33.A O no hydrogen 2.852 N/A CYS 51.A N ASP 216.A O no hydrogen 2.903 N/A CYS 51.A SG SER 31.A O no hydrogen 3.538 N/A CYS 51.A SG THR 53.A OG1 no hydrogen 3.297 N/A CYS 51.A SG GLY 54.A O no hydrogen 3.220 N/A THR 52.A N SER 31.A O no hydrogen 3.008 N/A LEU 56.A N ASP 216.A OD2 no hydrogen 2.741 N/A TRP 60.A NE1 ASP 216.A OD1 no hydrogen 2.896 N/A THR 62.A N PRO 59.A O no hydrogen 3.007 N/A THR 62.A OG1 PRO 59.A O no hydrogen 2.700 N/A THR 62.A OG1 TYR 106.A OH no hydrogen 2.808 N/A LEU 63.A N TRP 60.A O no hydrogen 2.864 N/A VAL 64.A N PRO 61.A O no hydrogen 3.353 N/A THR 65.A OG1 HIS 181.A NE2 no hydrogen 2.663 N/A THR 66.A N LEU 63.A O no hydrogen 3.004 N/A PHE 67.A N LEU 63.A O no hydrogen 2.961 N/A CYS 70.A N TYR 92.A OH no hydrogen 3.335 N/A CYS 70.A SG TYR 92.A OH no hydrogen 3.908 N/A PHE 71.A N LEU 68.A O no hydrogen 3.041 N/A ALA 72.A N MET 69.A O no hydrogen 3.015 N/A ARG 73.A N VAL 224.A O no hydrogen 2.829 N/A TYR 74.A OH HIS 199.A NE2 no hydrogen 2.754 N/A HIS 77.A NE2 ILE 229.A O no hydrogen 2.452 N/A MET 78.A N PRO 75.A O no hydrogen 2.918 N/A LYS 79.A N ASP 76.A O no hydrogen 3.292 N/A LYS 79.A NZ TYR 74.A O no hydrogen 3.228 N/A HIS 81.A N MET 78.A O no hydrogen 2.772 N/A ASP 82.A N LYS 79.A O no hydrogen 3.474 N/A LYS 85.A N ASP 82.A OD1 no hydrogen 3.149 N/A LYS 85.A NZ CYS 70.A O no hydrogen 2.816 N/A LYS 85.A NZ ALA 72.A O no hydrogen 2.805 N/A LYS 85.A NZ ASP 82.A OD2 no hydrogen 2.807 N/A SER 86.A N ASP 82.A O no hydrogen 3.390 N/A SER 86.A OG PHE 83.A O no hydrogen 2.857 N/A ALA 87.A N PHE 83.A O no hydrogen 3.137 N/A MET 88.A N LYS 85.A O no hydrogen 3.044 N/A GLY 91.A N ALA 87.A O no hydrogen 2.796 N/A TYR 92.A N VAL 112.A O no hydrogen 2.846 N/A VAL 93.A N THR 186.A O no hydrogen 2.802 N/A GLN 94.A N ALA 110.A O no hydrogen 2.808 N/A GLU 95.A N GLN 184.A O no hydrogen 2.865 N/A ARG 96.A N THR 108.A O no hydrogen 2.913 N/A ARG 96.A NE GLN 183.A OE1 no hydrogen 2.906 N/A ARG 96.A NH1 THR 65.A O no hydrogen 2.844 N/A ARG 96.A NH2 GLN 183.A OE1 no hydrogen 2.950 N/A THR 97.A N TYR 182.A O no hydrogen 2.923 N/A ILE 98.A N TYR 106.A O no hydrogen 2.824 N/A PHE 99.A N ASP 180.A O no hydrogen 2.857 N/A PHE 100.A N GLY 104.A O no hydrogen 2.921 N/A LYS 101.A N LEU 178.A O no hydrogen 2.995 N/A ASP 103.A N PHE 100.A O no hydrogen 2.921 N/A GLY 104.A N ASP 103.A OD1 no hydrogen 2.735 N/A ASN 105.A N ILE 128.A O no hydrogen 3.024 N/A TYR 106.A N ILE 98.A O no hydrogen 2.856 N/A TYR 106.A OH THR 62.A OG1 no hydrogen 2.808 N/A LYS 107.A N LYS 126.A O no hydrogen 2.697 N/A THR 108.A N ARG 96.A O no hydrogen 2.905 N/A ARG 109.A N GLU 124.A O no hydrogen 2.986 N/A ARG 109.A NH1 GLU 95.A OE2 no hydrogen 2.927 N/A ARG 109.A NH2 GLU 111.A OE2 no hydrogen 2.971 N/A ALA 110.A N GLN 94.A O no hydrogen 2.820 N/A GLU 111.A N ARG 122.A O no hydrogen 2.930 N/A VAL 112.A N TYR 92.A O no hydrogen 2.840 N/A LYS 113.A N VAL 120.A O no hydrogen 2.972 N/A PHE 114.A N PRO 89.A O no hydrogen 3.249 N/A GLU 115.A N THR 118.A O no hydrogen 2.781 N/A THR 118.A N GLU 115.A O no hydrogen 3.110 N/A LEU 119.A N PRO 16.A O no hydrogen 2.990 N/A VAL 120.A N LYS 113.A O no hydrogen 2.820 N/A ASN 121.A N LEU 18.A O no hydrogen 2.924 N/A ASN 121.A ND2 THR 66.A O no hydrogen 3.510 N/A ASN 121.A ND2 PHE 67.A O no hydrogen 2.965 N/A ARG 122.A N GLU 111.A O no hydrogen 2.942 N/A ILE 123.A N GLU 20.A O no hydrogen 2.799 N/A GLU 124.A N ARG 109.A O no hydrogen 2.889 N/A LEU 125.A N ASP 22.A O no hydrogen 2.850 N/A LYS 126.A N LYS 107.A O no hydrogen 2.830 N/A GLY 127.A N ASP 24.A O no hydrogen 2.759 N/A ILE 128.A N ASN 105.A O no hydrogen 2.987 N/A PHE 130.A N ASN 26.A OD1 no hydrogen 3.008 N/A LYS 131.A N ASP 103.A OD1 no hydrogen 2.809 N/A LYS 131.A NZ ASP 102.A O no hydrogen 2.784 N/A GLY 134.A N LYS 131.A O no hydrogen 3.040 N/A ASN 135.A ND2 GLN 177.A OE1 no hydrogen 2.779 N/A GLY 138.A N GLY 134.A O no hydrogen 2.793 N/A HIS 139.A N ILE 136.A O no hydrogen 3.005 N/A LYS 140.A N ASN 135.A O no hydrogen 2.967 N/A GLU 142.A N ASN 170.A O no hydrogen 2.800 N/A TYR 143.A OH SER 208.A O no hydrogen 2.774 N/A ASN 144.A ND2 GLU 142.A OE1 no hydrogen 2.990 N/A ASN 146.A ND2 ARG 168.A O no hydrogen 2.910 N/A ASN 146.A ND2 ASN 170.A OD1 no hydrogen 3.562 N/A SER 147.A OG TYR 203.A O no hydrogen 3.372 N/A HIS 148.A N TYR 203.A O no hydrogen 3.133 N/A VAL 150.A N LEU 201.A O no hydrogen 2.989 N/A ILE 152.A N HIS 199.A O no hydrogen 2.711 N/A MET 153.A N LYS 162.A O no hydrogen 2.953 N/A ASP 155.A N GLY 160.A O no hydrogen 2.847 N/A LYS 158.A N ASP 155.A O no hydrogen 2.957 N/A ASN 159.A N LYS 156.A O no hydrogen 3.084 N/A GLY 160.A N ASP 155.A O no hydrogen 3.185 N/A ILE 161.A N ASN 185.A O no hydrogen 3.009 N/A LYS 162.A N MET 153.A O no hydrogen 2.798 N/A VAL 163.A N GLN 183.A O no hydrogen 2.903 N/A PHE 165.A N HIS 181.A O no hydrogen 2.996 N/A LYS 166.A NZ ASP 180.A OD2 no hydrogen 3.527 N/A ILE 167.A N ALA 179.A O no hydrogen 2.889 N/A ARG 168.A N HIS 148.A NE2 no hydrogen 3.450 N/A HIS 169.A N GLN 177.A O no hydrogen 2.900 N/A ILE 171.A N SER 175.A O no hydrogen 2.921 N/A GLU 172.A N LYS 140.A O no hydrogen 2.893 N/A GLY 174.A N ILE 171.A O no hydrogen 3.005 N/A SER 175.A N ASP 173.A OD1 no hydrogen 2.815 N/A VAL 176.A N SER 175.A OG no hydrogen 2.670 N/A GLN 177.A N HIS 169.A O no hydrogen 2.846 N/A GLN 177.A NE2 LYS 101.A O no hydrogen 2.878 N/A GLN 177.A NE2 LEU 178.A O no hydrogen 3.106 N/A ALA 179.A N ILE 167.A O no hydrogen 2.771 N/A ASP 180.A N PHE 99.A O no hydrogen 2.877 N/A HIS 181.A N PHE 165.A O no hydrogen 2.760 N/A HIS 181.A ND1 ALA 179.A O no hydrogen 2.997 N/A HIS 181.A NE2 THR 65.A OG1 no hydrogen 2.663 N/A TYR 182.A N THR 97.A O no hydrogen 2.809 N/A GLN 183.A N VAL 163.A O no hydrogen 2.826 N/A GLN 183.A NE2 ASN 185.A OD1 no hydrogen 2.910 N/A GLN 184.A N GLU 95.A O no hydrogen 2.935 N/A GLN 184.A NE2 ASP 155.A OD2 no hydrogen 2.847 N/A ASN 185.A N ILE 161.A O no hydrogen 2.960 N/A ASN 185.A ND2 GLN 94.A OE1 no hydrogen 2.884 N/A THR 186.A N VAL 93.A O no hydrogen 3.064 N/A ILE 188.A N GLY 91.A O no hydrogen 2.803 N/A LEU 194.A N SER 86.A OG no hydrogen 2.840 N/A ASP 197.A N HIS 81.A ND1 no hydrogen 3.273 N/A HIS 199.A N ILE 152.A O no hydrogen 3.209 N/A HIS 199.A ND1 ASP 197.A O no hydrogen 2.796 N/A HIS 199.A NE2 TYR 74.A OH no hydrogen 2.754 N/A TYR 200.A N ALA 227.A O no hydrogen 2.982 N/A LEU 201.A N VAL 150.A O no hydrogen 2.823 N/A SER 202.A N THR 225.A O no hydrogen 2.818 N/A TYR 203.A N HIS 148.A O no hydrogen 2.827 N/A GLN 204.A N PHE 223.A O no hydrogen 3.061 N/A SER 205.A OG GLU 222.A OE2 no hydrogen 2.779 N/A ALA 206.A N LEU 221.A O no hydrogen 2.846 N/A SER 208.A N VAL 219.A O no hydrogen 2.801 N/A LYS 209.A NZ TYR 143.A OH no hydrogen 3.545 N/A LYS 209.A NZ HIS 217.A O no hydrogen 2.733 N/A ASP 210.A N HIS 217.A NE2 no hydrogen 2.696 N/A ASN 212.A N ASP 210.A OD1 no hydrogen 3.006 N/A GLU 213.A N ASP 210.A O no hydrogen 2.996 N/A ARG 215.A N GLU 213.A OE2 no hydrogen 2.943 N/A ARG 215.A NE GLU 213.A OE2 no hydrogen 2.750 N/A ARG 215.A NH2 GLU 213.A OE1 no hydrogen 3.068 N/A ARG 215.A NH2 GLU 213.A OE2 no hydrogen 3.567 N/A HIS 217.A ND1 ARG 215.A O no hydrogen 2.919 N/A MET 218.A N PHE 49.A O no hydrogen 2.885 N/A VAL 219.A N SER 208.A O no hydrogen 2.956 N/A LEU 220.A N LEU 47.A O no hydrogen 2.809 N/A LEU 221.A N ALA 206.A O no hydrogen 2.972 N/A GLU 222.A N LEU 45.A O no hydrogen 3.040 N/A PHE 223.A N GLN 204.A O no hydrogen 2.930 N/A VAL 224.A N GLY 43.A O no hydrogen 2.768 N/A THR 225.A N SER 202.A O no hydrogen 3.179 N/A ALA 226.A N ARG 73.A O no hydrogen 2.853 N/A ALA 227.A N TYR 200.A O no hydrogen 2.898 N/A